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Di-tert-butyl 4-(1,4,4-trimethyl-3-oxopentyl)-2,3-dimethylpentadioate
SpectraBase Compound ID AiLr3fFxLFa
InChI InChI=1S/C23H42O5/c1-14(13-17(24)21(4,5)6)18(20(26)28-23(10,11)12)15(2)16(3)19(25)27-22(7,8)9/h14-16,18H,13H2,1-12H3
InChIKey QVTKOACQKGORLJ-UHFFFAOYSA-N
Mol Weight 398.6 g/mol
Molecular Formula C23H42O5
Exact Mass 398.303224 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8ABFKnFCMRL
Name Di-tert-butyl 4-(1,4,4-trimethyl-3-oxopentyl)-2,3-dimethylpentadioate
Alternate Name(s) di(tert-butyl) 2,3-dimethyl-4-(1,4,4-trimethyl-3-oxopentyl)pentanedioate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H42O5
InChI InChI=1S/C23H42O5/c1-14(13-17(24)21(4,5)6)18(20(26)28-23(10,11)12)15(2)16(3)19(25)27-22(7,8)9/h14-16,18H,13H2,1-12H3
InChIKey QVTKOACQKGORLJ-UHFFFAOYSA-N
Molecular Weight 398.584 g/mol
SMILES C(C(C(C(C(OC(C)(C)C)=O)C)C)C(CC(C(C)(C)C)=O)C)(OC(C)(C)C)=O
SPLASH splash10-000e-0039000000-0e97b72e8e31abe5f3ec
Source of Spectrum SO-0-652-6
Wiley ID 1542357